ethyl 3-[3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 3-[3-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate CAS Name: 3-[[3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-1-oxopropyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate Traditional Name: 3-[3-[4-(5-chloro-2-methyl-phenyl)piperazino]propanoylamino]-1H-indole-2-carboxylic acid ethyl ester Formula: C25H29ClN4O3 MolecularWeight: 468.97576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CCN3CCN(CC3)C4=C(C=CC(=C4)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CCN3CCN(CC3)C4=C(C=CC(=C4)Cl)C

InChI

InChI=1S/C25H29ClN4O3/c1-3-33-25(32)24-23(19-6-4-5-7-20(19)27-24)28-22(31)10-11-29-12-14-30(15-13-29)21-16-18(26)9-8-17(21)2/h4-9,16,27H,3,10-15H2,1-2H3,(H,28,31)